Energetics of MnO_2 polymorphs in density functional theory

著录项

• 来源
  《Physical review》 |2016年第4期|045132.1-045132.5|共5页
• 作者

  Daniil A. Kitchaev; Haowei Peng; Yun Liu; Jianwei Sun; John P. Perdew; Gerbrand Ceder;

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• 作者单位

  Department of Materials Science and Engineering, Massachusetts Institute of Technology, Cambridge, Massachusetts 02139, USA;

  Department of Physics, Temple University, Philadelphia, Pennsylvania 19122, USA;

  Department of Materials Science and Engineering, Massachusetts Institute of Technology, Cambridge, Massachusetts 02139, USA;

  Department of Physics, Temple University, Philadelphia, Pennsylvania 19122, USA;

  Department of Physics, Temple University, Philadelphia, Pennsylvania 19122, USA,Department of Chemistry, Temple University, Philadelphia, Pennsylvania 19122, USA;

  Department of Materials Science and Engineering, Massachusetts Institute of Technology, Cambridge, Massachusetts 02139, USA,Department of Materials Science and Engineering, University of California Berkeley, Berkeley, California 94720, USA,Materials Science Division, Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA;

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• 正文语种 eng
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